ChemSpider 2D Image | 4-Methyl-3-({3-[2-(Methylamino)pyrimidin-4-Yl]pyridin-2-Yl}oxy)-N-[2-Morpholin-4-Yl-5-(Trifluoromethyl)phenyl]benzamide | C29H27F3N6O3

4-Methyl-3-({3-[2-(Methylamino)pyrimidin-4-Yl]pyridin-2-Yl}oxy)-N-[2-Morpholin-4-Yl-5-(Trifluoromethyl)phenyl]benzamide

  • Molecular FormulaC29H27F3N6O3
  • Average mass564.558 Da
  • Monoisotopic mass564.209656 Da
  • ChemSpider ID13168835

More details:






Validated by Experts, Validated by Users, Non-Validated, Removed by Users

4-Methyl-3-({3-[2-(methylamino)-4-pyrimidinyl]-2-pyridinyl}oxy)-N-[2-(4-morpholinyl)-5-(trifluormethyl)phenyl]benzamid [German] [ACD/IUPAC Name]
4-Methyl-3-({3-[2-(methylamino)-4-pyrimidinyl]-2-pyridinyl}oxy)-N-[2-(4-morpholinyl)-5-(trifluoromethyl)phenyl]benzamide [ACD/IUPAC Name]
4-Méthyl-3-({3-[2-(méthylamino)-4-pyrimidinyl]-2-pyridinyl}oxy)-N-[2-(4-morpholinyl)-5-(trifluorométhyl)phényl]benzamide [French] [ACD/IUPAC Name]
4-Methyl-3-({3-[2-(Methylamino)pyrimidin-4-Yl]pyridin-2-Yl}oxy)-N-[2-Morpholin-4-Yl-5-(Trifluoromethyl)phenyl]benzamide
Benzamide, 4-methyl-3-[[3-[2-(methylamino)-4-pyrimidinyl]-2-pyridinyl]oxy]-N-[2-(4-morpholinyl)-5-(trifluoromethyl)phenyl]- [ACD/Index Name]
MR9
pyridinyl pyrimidine 47

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.4±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.626
Molar Refractivity: 147.4±0.3 cm3
#H bond acceptors: 9
#H bond donors: 2
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 1
ACD/LogP: 4.61
ACD/LogD (pH 5.5): 4.46
ACD/BCF (pH 5.5): 1446.85
ACD/KOC (pH 5.5): 6353.48
ACD/LogD (pH 7.4): 4.47
ACD/BCF (pH 7.4): 1456.36
ACD/KOC (pH 7.4): 6395.21
Polar Surface Area: 102 Å2
Polarizability: 58.4±0.5 10-24cm3
Surface Tension: 57.1±3.0 dyne/cm
Molar Volume: 416.4±3.0 cm3

Click to predict properties on the Chemicalize site






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